BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
Member of WWPDB

8-anilino-1-naphthalenesulfonic Acid

Graphical representations:

8-anilino-1-naphthalenesulfonic acid image

Molecular Formula: C16 H13 N O3 S

Natural Isotopic Abundance Mass: 299.34432

Mono-Isotopic Molecular Masses:

  • C12N14: 299.0616139788
  • C13N14: 315.1152913836
  • C12N15: 300.058648872
  • C13N15: 316.1123262768

InCHi String:

canonical and isomeric SMILES: C1=CC=C(C=C1)NC2=CC=CC3=C2C(=CC=C3)S(=O)(=O)O

PUBCHEM iupac NAME: PUBCHEM iupac TRADITIONAL NAME: PUBCHEM iupac OPENEYE NAME
8-anilinonaphthalene-1-sulfonic acid

PUBCHEM iupac CAS NAME
8-anilino-1-naphthalenesulfonic acid

PUBCHEM iupac SYSTEMATIC NAME
8-phenylazanylnaphthalene-1-sulfonic acid

PubChem Substance (SID):   111677848   24890494   26697363
PubChem Compound (CID):   1369
KEGG: Compound ID   C11326
CAS Registry IDs:   82-76-8
PDB Chemical Component   2AN
Miscellaneous Databases and IDs:   Sigma-Aldrich A1028_SIAL   ChEBI CHEBI:39708   MMCD cq_07969   MDL MFCD00003998

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.